sodium 1-oxidanylidene-1-propoxy-octadecane-9-sulfonate

Systemtic Name: sodium 1-oxidanylidene-1-propoxy-octadecane-9-sulfonate Openeye Name: sodium 1-oxo-1-propoxy-octadecane-9-sulfonate CAS Name: sodium 1-oxo-1-propoxy-9-octadecanesulfonate IUPAC Name: sodium 1-oxo-1-propoxyoctadecane-9-sulfonate Traditional Name: sodium 1-keto-1-propoxy-octadecane-9-sulfonate Formula: C21H41NaO5S MolecularWeight: 428.60201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCCC(=O)OCCC)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCC(CCCCCCCC(=O)OCCC)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C21H42O5S.Na/c1-3-5-6-7-8-10-13-16-20(27(23,24)25)17-14-11-9-12-15-18-21(22)26-19-4-2;/h20H,3-19H2,1-2H3,(H,23,24,25);/q;+1/p-1